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(2R)-2-[({6-[(6-{[(1R)-1-carboxyethyl]carbamoyl}-2-{[(6aR,6bS,8aS,11S,14bS)-11-{[(1S)-1-carboxyethyl]carbamoyl}-4,4,6a,6b,8a,11,14b-heptamethyl-14-oxo-1,2,3,4,4a,5,6,6a,6b,7,8,8a,9,10,11,12,12a,14,14a,14b-icosahydropicen-3-yl]oxy}-4,5-dihydroxytetrahydro-

Catalog ID
STL565040
SMILES OC(=O)[C@H](NC(=O)C1OC(OC2CC[C@]3(C(C2(C)C)CC[C@@]2(C3C(=O)C=C3[C@@]2(C)CC[C@@]2(C3C[C@](C)(CC2)C(=O)N[C@H](C(=O)O)C)C)C)C)C(C(C1O)O)OC1OC(C(=O)N[C@@H](C(=O)O)C)C(C(C1O)O)O)C

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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 C51H77N3O19 MW 1036.18 g/mol Purity >90% as per NMR
InChI
InChI=1S/C51H77N3O19/c1-21(40(63)64)52-38(61)34-30(57)29(56)33(60)43(71-34)73-36-32(59)31(58)35(39(62)53-22(2)41(65)66)72-44(36)70-28-12-13-49(8)27(46(28,4)5)11-14-51(10)37(49)26(55)19-24-25-20-48(7,45(69)54-23(3)42(67)68)16-15-47(25,6)17-18-50(24,51)9/h1
InChIKey
YJSTZSXUCLOVKE-HJOCKEIGSA-N
Synonyms

(2R)2(((6((6(((1R)1carboxyethyl)carbamoyl)2(((6aR6bS8aS11S14bS)11(((1S)1carboxyethyl)carbamoyl)446a6b8a1114bheptamethyl14oxo12344a566a6b788a910111212a1414a14bicosahydropicen3yl)oxy)45dihydroxytetrahydro
(2R)2((6(2(((6aR6bS8aS11S14bS)11(((1S)1carboxyethyl)carbamoyl)446a6b8a1114bheptamethyl14oxo234a56789101212a14adodecahydro1Hpicen3yl)oxy)6(((1R)1carboxyethyl)carbamoyl)45dihydroxyoxan3yl)oxy345trihydroxyoxane2carbonyl)amino)propanoicacid
44661322
InChI=1SC51H77N3O19c121(40(63)64)5238(61)3430(57)29(56)33(60)43(7134)733632(59)31(58)35(39(62)5322(2)41(65)66)7244(36)7028121349(8)27(46(284)5)111451(10)37(49)26(55)1924252048(745(69)5423(3)42(67)68)161547(256)171850(2451)9h19212325273743445660H11182
OC(=O)(C@H)(NC(=O)C1OC(OC2CC(C@)3(C(C2(C)C)CC(C@@)2(C3C(=O)C=C3(C@@)2(C)CC(C@@)2(C3C(C@)(C)(CC2)C(=O)N(C@H)(C(=O)O)C)C)C)C)C(C(C1O)O)OC1OC(C(=O)N(C@@H)(C(=O)O)C)C(C(C1O)O)O)C

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Available files

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