1-(1,3a-dihydroxy-7-{[(2r,4s,5s,6s)-5-{[(2s,4s,5s,6s)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl]oxy}-9a,11a-dimethyl-11-[(3-methylbutanoyl)oxy]-dodecahydro-2h-cyclopenta[a]phenanthren-1-yl)ethyl 3-methylbutanoate

1-(1,3a-dihydroxy-7-{[(2r,4s,5s,6s)-5-{[(2s,4s,5s,6s)-5-hydroxy-4-methoxy-6-methyloxan-2-yl]oxy}-4-methoxy-6-methyloxan-2-yl]oxy}-9a,11a-dimethyl-11-[(3-methylbutanoyl)oxy]-dodecahydro-2h-cyclopenta[a]phenanthren-1-yl)ethyl 3-methylbutanoate

Formula: C45H76O13 (824.5286)
Chinese Name:
BioDeep ID: BioDeep_00002275695 ( View LC/MS Profile)
SMILES: CO[C@H]1C[C@H](O[C@H]2[C@H](C)O[C@@H](OC3CCC4(C)C(CCC5C4CC(OC(=O)CC(C)C)C4(C)C(O)(C(C)OC(=O)CC(C)C)CCC54O)C3)C[C@@H]2OC)O[C@@H](C)[C@@H]1O



Found 1 Sample Hits

m/z Adducts Species Organ Scanning Sample
824.5559 [M-H2O+NH4]+
PPM:4.9		 Vitis vinifera Fruit MALDI (DHB)
grape_dhb_164_1 - Grape Database
Resolution: 17μm, 136x122

Description

Grape berries fruit, condition: Late