(Q105283709)

English

(2R,3R,4S,5S,6R)-2-{[(1S,3aR,3bR,5S,5aR,7S,9aR,9bR,11R,11aR)-1-[(2R,4E)-6-hydroperoxy-2-hydroxy-6-methylhept-4-en-2-yl]-7,11-dihydroxy-3a,3b,6,6,9a-pentamethyl-dodecahydro-1H-cyclopenta[a]phenanthren-5-yl]oxy}-6-(hydroxymethyl)oxane-3,4,5-triol

chemical compound

In more languages

default for all languages

No label defined

No description defined

Statements

type of chemical entity

0 references

2-[[17-(6-hydroperoxy-2-hydroxy-6-methylhept-4-en-2-yl)-3,12-dihydroxy-4,4,8,10,14-pentamethyl-2,3,5,6,7,9,11,12,13,15,16,17-dodecahydro-1H-cyclopenta[a]phenanthren-6-yl]oxy]-6-(hydroxymethyl)oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

670.429212804 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₆₂O₁₁

0 references

canonical SMILES

OOC(C=CCC(O)(C)C1CCC2(C)C1C(O)CC3C4(C)CCC(O)C(C)(C)C4C(OC5OC(CO)C(O)C(O)C5O)CC32C)(C)C

0 references

isomeric SMILES

CC(C)(/C=C/C[C@@](C)(O)[C@H]1CC[C@]2(C)[C@@H]1[C@H](O)C[C@@H]1[C@@]3(C)CC[C@H](O)C(C)(C)[C@@H]3[C@@H](O[C@@H]3O[C@H](CO)[C@@H](O)[C@H](O)[C@H]3O)C[C@]12C)OO

0 references

1 reference

Dammarane-Type Glycosides from the Steamed Flower-Buds of Panax ginseng

Identifiers

InChI=1S/C36H62O11/c1-31(2,47-44)12-9-13-36(8,43)19-10-15-34(6)25(19)20(38)16-23-33(5)14-11-24(39)32(3,4)29(33)21(17-35(23,34)7)45-30-28(42)27(41)26(40)22(18-37)46-30/h9,12,19-30,37-44H,10-11,13-18H2,1-8H3/b12-9+/t19-,20+,21-,22+,23+,24-,25-,26+,27-,28+,29-,30+,33+,34+,35+,36+/m0/s1

0 references

VCIATBKNMKVKOS-WJMGSXJKSA-N

0 references

2 references

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

VCIATBKNMKVKOS-WJMGSXJKSA-N

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