Loihichelins; Loihichelin C

AlkaPlorer ID: AK304583

Synonym: None

IUPAC Name: None

Structure

SMILES: C/C=C(\NC(=O)C(CCCN(O)C(C)=O)NC(=O)C(CO)NC(=O)C(CCC(N)=O)NC(=O)C(CO)NC(=O)C(NC(=O)CCC/C=C\CCCCCC)C(O)C(=O)O)C(=O)NC(CO)C(=O)NC1CCCN(O)C1=O

copy

InChI: InChI=1S/C46H75N11O19/c1-4-6-7-8-9-10-11-12-13-18-35(63)55-36(37(64)46(73)74)44(71)54-33(25-60)42(69)50-29(19-20-34(47)62)40(67)53-31(23-58)41(68)49-28(16-14-21-56(75)26(3)61)39(66)48-27(5-2)38(65)52-32(24-59)43(70)51-30-17-15-22-57(76)45(30)72/h5,10-11,28-33,36-37,58-60,64,75-76H,4,6-9,12-25H2,1-3H3,(H2,47,62)(H,48,66)(H,49,68)(H,50,69)(H,51,70)(H,52,65)(H,53,67)(H,54,71)(H,55,63)(H,73,74)/b11-10-,27-5-

copy

InChIKey: INUZTVUOUNUWAD-SPORIGEOSA-N

copy

Reference

CAS: 1133940-12-1

Source

Properties Information

Molecule Weight: 1086.1639999999998

TPSA: 475.19

MolLogP: -5.18570000000002

Number of H-Donors: 16

Number of H-Acceptors: 18

RingCount: 1

Activities Information

Organism Target Name Standard Type Standard Value Standard Units doi

Metabolism Information