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3-[(3S,11E)-14,16-dihydroxy-3-methyl-1,7-dioxo-3,4,5,6,7,8,9,10-octahydro-1H-2-benzoxacyclotetradecin-15-yl]-N-[(4-methoxy-6-methyl-5,6,7,8-tetrahydro[1,3]dioxolo[4,5-g]isoquinolin-9-yl)methyl]-3-(4-methoxyphenyl)propanamide

Catalog ID
STL561542
SMILES COc1ccc(cc1)C(c1c(O)cc2c(c1O)C(=O)O[C@@H](C)CCCC(=O)CCC/C=C/2)CC(=O)NCc1c2CCN(Cc2c(c2c1OCO2)OC)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 C41H48N2O10 MW 728.84 g/mol Purity >90% as per NMR
InChI
InChI=1S/C41H48N2O10/c1-24-9-8-12-27(44)11-7-5-6-10-26-19-33(45)36(37(47)35(26)41(48)53-24)30(25-13-15-28(49-3)16-14-25)20-34(46)42-21-31-29-17-18-43(2)22-32(29)38(50-4)40-39(31)51-23-52-40/h6,10,13-16,19,24,30,45,47H,5,7-9,11-12,17-18,20-23H2,1-4H3,(H,42
InChIKey
ARKWELGWPFNSTR-WSBGRJEFSA-N
Synonyms

145704899
3((3S11E)1416dihydroxy3methyl17dioxo345678910octahydro1H2benzoxacyclotetradecin15yl)N((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)methyl)3(4methoxyphenyl)propanamide
3((4S12E)1618dihydroxy4methyl28dioxo3oxabicyclo(1240)octadeca1(18)121416tetraen17yl)N((4methoxy6methyl78dihydro5H(13)dioxolo(45g)isoquinolin9yl)methyl)3(4methoxyphenyl)propanamide
3((SE)1416dihydroxy3methyl17dioxo345678910octahydro1Hbenzo(c)(1)oxacyclotetradecin15yl)N((4methoxy6methyl5678tetrahydro(13)dioxolo(45g)isoquinolin9yl)methyl)3(4methoxyphenyl)propanamide
COc1ccc(cc1)C(c1c(O)cc2c(c1O)C(=O)O(C@@H)(C)CCCC(=O)CCCC=C2)CC(=O)NCc1c2CCN(Cc2c(c2c1OCO2)OC)C
InChI=1SC41H48N2O10c124981227(44)1175610261933(45)36(37(47)35(26)41(48)5324)30(25131528(493)161425)2034(46)42213129171843(2)2232(29)38(504)4039(31)51235240h61013161924304547H579111217182023H214H3(H4246)b106+t2430?m0s1
MFCD32650608
ZINC001848442562
ZINC001848442563

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Available files

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