(Q104993298)

English

(3R)-4-[2-[[(1S,2R,3R,4S,5R,6S,8R,9S,10S,13S,16S,17R,18S)-11-ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl]methoxycarbonyl]anilino]-3-methyl-4-oxobutanoic acid

chemical compound

In more languages

Statements

type of chemical entity

0 references

4-[2-[(11-Ethyl-8,9-dihydroxy-4,6,16,18-tetramethoxy-11-azahexacyclo[7.7.2.12,5.01,10.03,8.013,17]nonadecan-13-yl)methoxycarbonyl]anilino]-3-methyl-4-oxobutanoic acid

1 reference

based on heuristic

inferred from SMILES

700.357110484 dalton

1 reference

based on heuristic

inferred from SMILES

chemical formula

C₃₇H₅₂N₂O₁₁

0 references

canonical SMILES

CCN1CC2(COC(=O)c3ccccc3NC(=O)C(C)CC(=O)O)CCC(OC)C34C5CC6C(OC)CC(O)(C5C6OC)C(O)(C(OC)C23)C14

0 references

isomeric SMILES

CCN1C[C@]2(COC(=O)c3ccccc3NC(=O)[C@H](C)CC(=O)O)CC[C@H](OC)[C@@]34[C@@H]5C[C@H]6[C@H](OC)[C@@H]5[C@](O)(C[C@@H]6OC)[C@@](O)([C@@H](OC)[C@H]23)[C@@H]14

0 references

Delphinium shawurense

1 reference

Shawurensine, a new C19-diterpenoid alkaloid from Delphinium shawurense

Delphinium umbrosum

1 reference

C19-Diterpenoid alkaloids from Delphinium umbrosum

Identifiers

InChI=1S/C37H52N2O11/c1-7-39-17-34(18-50-32(43)20-10-8-9-11-23(20)38-31(42)19(2)14-26(40)41)13-12-25(47-4)36-22-15-21-24(46-3)16-35(44,27(22)28(21)48-5)37(45,33(36)39)30(49-6)29(34)36/h8-11,19,21-22,24-25,27-30,33,44-45H,7,12-18H2,1-6H3,(H,38,42)(H,40,41)/t19-,21-,22-,24+,25+,27-,28+,29-,30+,33+,34+,35-,36+,37-/m1/s1

0 references

FCRRDBSGFPBRDY-CRNWGPEESA-N

0 references

2 references

17 September 2022

based on heuristic

inferred from InChIKey

matched by identifier from

FCRRDBSGFPBRDY-CRNWGPEESA-N

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