NSC676794
Molecular Formula:
C58H92O26
InChI: InChI=1/C58H92O26/c1-24-40(80-46-37(67)33(63)27(60)20-75-46)41(81-50-44(70)57(73,22-59)23-77-50)39(69)48(78-24)83-43-34(64)28(61)21-76-49(43)84-51(72)58-17-16-52(2,3)18-26(58)25-10-11-30-54(6)14-13-32(79-47-38(68)35(65)36(66)42(82-47)45(71)74-9)53(4,5)29(54)12-15-55(30,7)56(25,8)19-31(58)62/h10,24,26-44,46-50,59-70,73H,11-23H2,1-9H3/t24u,26-,27?,28?,29-,30+,31+,32-,33?,34?,35?,36?,37?,38?,39?,40?,41?,42u,43?,44?,46?,47?,48?,49?,50?,54-,55+,56+,57?,58+/m0/s1
InChIKey: InChIKey=OOAPEJATVYBYAK-XLVFPZBQBM
SMILES: CC1C(C(C(C(O1)OC2C(C(COC2OC(=O)C34CCC(CC3C5=CCC6C7(CCC(C(C7CCC6(C5(CC4O)C)C)(C)C)OC8C(C(C(C(O8)C(=O)OC)O)O)O)C)(C)C)O)O)O)OC9C(C(CO9)(CO)O)O)OC1C(C(C(CO1)O)O)O
Names:
methyl 6-[[(3S,4aR,6aR,6bS,8R,8aR,12aR,14aR,14bS)-8a-[3-[4-[3,4-dihydroxy-4-(hydroxymethyl)oxolan-2-yl]oxy-3-hydroxy-6-methyl-5-(3,4,5-trihydroxyoxan-2-yl)oxy-oxan-2-yl]oxy-4,5-dihydroxy-oxan-2-yl]oxycarbonyl-8-hydroxy-4,4,6a,6b,11,11,14b-heptamethyl-1,2,3,4a,5,6,7,8,9,10,12,12a,14,14a-tetradecahydropicen-3-yl]oxy]-3,4,5-trihydroxy-oxane-2-carboxylate
NSC676794
Registries:
PubChem CID 385536
PubChem ID 8142456
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