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methyl (5S,7S,9S)-9-[(2beta,3beta,4beta,5alpha,12beta,19alpha)-3-carbamoyl-3,4-dihydroxy-16-methoxy-1-methyl-6,7-didehydroaspidospermidin-15-yl]-5-ethyl-5-hydroxy-1,4,5,6,7,8,9,10-octahydro-2H-3,7-methanoazacycloundecino[5,4-b]indole-9-carboxylate

Catalog ID
STL565153
SMILES COc1cc2N(C)[C@@H]3[C@@]4(c2cc1[C@]1(C[C@@H]2CN(CCc5c1[nH]c1c5cccc1)C[C@](C2)(O)CC)C(=O)OC)CCN1[C@H]4[C@@]([C@H]([C@]3(O)C(=O)N)O)(CC)C=CC1

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We supply compounds in quantities from 1 mg up to 5 g for research and development purposes only.

We do not supply quantities above 5 g.

Structure and other identifiers

2D representation rendered from the SMILES, with core physicochemical data.
Formula C43H55N5O7 MW 753.94 g/mol Purity >90% as per NMR
InChI
InChI=1S/C43H55N5O7/c1-6-39(52)21-25-22-42(38(51)55-5,33-27(13-17-47(23-25)24-39)26-11-8-9-12-30(26)45-33)29-19-28-31(20-32(29)54-4)46(3)35-41(28)15-18-48-16-10-14-40(7-2,34(41)48)36(49)43(35,53)37(44)50/h8-12,14,19-20,25,34-36,45,49,52-53H,6-7,13,15-18,2
InChIKey
HHJUWIANJFBDHT-KOTLKJBCSA-N
Synonyms

3(AMINOCARBONYL)O(4)DEACETYL3DE(METHOXYCARBONYL)VINCALEUKOBLASTINE
3(AMINOCARBONYL)O(SUP4)DEACETYL3DE(METHOXYCARBONYL)VINCALEUKOBLASTINE
3CARBAMOYL4DEACETYL3DE(METHOXYCARBONYL)VINCALEUKOBLASTINE
3CARBAMOYLO(4)DEACETYL3DE(METHOXYCARBONYL)VINCALEUKOBLASTINE
40839
DESACETYLVINBLASTINEAMIDE
DESACETYLVINBLASTINEAMIDESULFATE
HANOAZACYCLOUNDECINO(54B)INDOLE9CARBOXYLATE
InChI=1SC43H55N5O7c1639(52)21252242(38(51)5553327(131747(2325)2439)2611891230(26)4533)29192831(2032(29)544)46(3)3541(28)15184816101440(7234(41)48)36(49)43(3553)37(44)50h81214192025343645495253H671315182124H215H3(H24450)t2534+353639+404142+43+m1s1
methyl(13S15S17S)13((1R9R10S11R12R19R)10carbamoyl12ethyl1011dihydroxy5methoxy8methyl816diazapentacyclo(106101902701619)nonadeca24613tetraen4yl)17ethyl17hydroxy111diazatetracyclo(133104120510)nonadeca4(12)579tetraene13carboxylate
methyl(5S7S9S)9((2beta3beta4beta5alpha12beta19alpha)3carbamoyl34dihydroxy16methoxy1methyl67didehydroaspidospermidin15yl)5ethyl5hydroxy145678910octahydro2H37methanoazacycloundecino(54b)indole9carboxylate
MFCD00866252
OS(=O)(=O)OCOc1cc2N(C)(C@@H)3(C@@)4(c2cc1(C@)1(C(C@@H)2CN(CCc5c1(nH)c1c5cccc1)C(C@)(C2)(O)CC)C(=O)OC)CCN1(C@H)4(C@@)((C@H)((C@)3(O)C(=O)N)O)(CC)C=CC1
VINCALEUKOBLASTINE23AMINOO(SUP4)DEACETYL23DEMETHOXY
VINCALEUKOBLASTINE3(AMINOCARBONYL)O(SUP4)DEACETYL3DE(METHOXYCARBONYL)
VINCALEUKOBLASTINE3(AMINOCARBONYL)O4DEACETYL3DE(METHOXYCARBONYL)
VINDESINE(USANINN)
VINDESINESULFATE
ZINC000008214470

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Available files

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