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Substance Name: Daphnilactone B
RN: 38826-56-1
InChIKey: AEJYSVZYGHPRNK-CQQPRXJCSA-N

Molecular Formula

  • C22-H31-N-O2

Molecular Weight

  • 341.492
 
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Names and Synonyms

Results Name

  • Daphnilactone B

Synonym

  • Daphnilactone B

Systematic Name

  • 6H,12H-8,11,17b-Metheno-3H,5H-oxepino(4',3':4,5)azuleno(6,5-c)azonin-3-one, 1,2,7,8,9,10,12a,13,14,14a,15,16-dodecahydro-9-methyl-, (5aR,8R,9S,12aS,14aR,17bR,18S)-

Registry Numbers

CAS Registry Number

  • 38826-56-1

System Generated Number

  • 0038826561

Structure Descriptors

InChI

1S/C22H31NO2/c1-14-11-23-12-16-6-5-15-3-2-4-18(15)22-10-8-19(24)25-13-21(16,22)9-7-17(14)20(22)23/h4,14-17,20H,2-3,5-13H2,1H3/t14-,15-,16-,17+,20-,21?,22?/m1/s1

InChIKey

AEJYSVZYGHPRNK-CQQPRXJCSA-N

Smiles

C1C[C@H]2[C@@]34[C@@](CCC(OC3)=O)(C=3[C@@H]1CCC3)[C@H]1[C@@H]([C@H](C)C[N@@]1C2)CC4