(Q105145546)

English

(2S,3R,4S,5R)-2-[[(3S,5R,7S,8S,10R,13R,14S,16S,17R)-7,16-dihydroxy-10-(hydroxymethyl)-4,4,13,14-tetramethyl-17-[(2R,4S,5S)-4,5,6-trihydroxy-6-methylheptan-2-yl]-2,3,5,6,7,8,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-3,4,5-triol

chemical compound

In more languages

Statements

type of chemical entity

0 references

2-[[7,16-dihydroxy-10-(hydroxymethyl)-4,4,13,14-tetramethyl-17-(4,5,6-trihydroxy-6-methylheptan-2-yl)-2,3,5,6,7,8,12,15,16,17-decahydro-1H-cyclopenta[a]phenanthren-3-yl]oxy]oxane-3,4,5-triol

1 reference

based on heuristic

inferred from SMILES

656.41356274 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₅H₆₀O₁₁

0 references

canonical SMILES

OCC12C3=CCC4(C)C(C(O)CC4(C)C3C(O)CC2C(C)(C)C(OC5OCC(O)C(O)C5O)CC1)C(C)CC(O)C(O)C(O)(C)C

0 references

isomeric SMILES

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

0 references

Astragalus orbiculatus

1 reference

Triterpene Glycosides of Astragalus and Their Genins. LXX. Orbicoside, the First Lanostane Glycoside from Astragalus Plants

Identifiers

InChI=1S/C35H60O11/c1-17(12-20(38)29(43)32(4,5)44)25-21(39)14-34(7)26-18(8-10-33(25,34)6)35(16-36)11-9-24(31(2,3)23(35)13-19(26)37)46-30-28(42)27(41)22(40)15-45-30/h8,17,19-30,36-44H,9-16H2,1-7H3/t17-,19+,20+,21+,22-,23+,24+,25+,26+,27+,28-,29+,30+,33-,34+,35+/m1/s1

0 references

KSQPBJVANTVWKR-AESFUGPLSA-N

0 references

2 references

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

KSQPBJVANTVWKR-AESFUGPLSA-N

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