(Q105152883)

English

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

group of stereoisomers with the chemical formula C₃₆H₆₂O₉

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Statements

instance of

group of stereoisomers

0 references

subclass of

protostane/dammarane triterpenoid

1 reference

inferred from

protostane/dammarane triterpenoid

mass

638.439383564 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₆H₆₂O₉

0 references

canonical SMILES

OCC(=CCCC(OC1OC(CO)C(O)C(O)C1O)(C)C2CCC3(C)C2CCC4C5(C)CCC(O)C(C)(C)C5C(O)CC43C)C

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found in taxon

Actinostemma lobatum

1 reference

stated in

Studies on the constituents of Actinostemma lobatum Maxim. I Structures of actinostemmosides A, B, C and D, dammarane triterpene glycosides isolated from the herb.

Identifiers

InChI

InChI=1S/C36H62O9/c1-20(18-37)9-8-14-36(7,45-31-29(43)28(42)27(41)24(19-38)44-31)22-12-16-34(5)21(22)10-11-25-33(4)15-13-26(40)32(2,3)30(33)23(39)17-35(25,34)6/h9,21-31,37-43H,8,10-19H2,1-7H3

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InChIKey

LJXHGBBGOLNHCU-UHFFFAOYSA-N

0 references

1 reference

17 September 2022

inferred from InChIKey

(Q105152883)

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

Statements

Identifiers

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