Secorapamycin B - CAS 185107-79-3

Secorapamycin B (Cat No.:C001129) is a macrocyclic polyketide antibiotic, a derivative of rapamycin. It exhibits promising antibacterial activity against certain Gram-positive bacteria, making it valuable in pharmaceutical research. This compound shows potential as an antibacterial agent for combating bacterial infections, and its structural similarities to rapamycin have sparked interest in its applications.

Catalog Number: C001129

CAS Number: 185107-79-3

Molecular Formula: C₅₁H₈₁NO₁₄

Molecular Weight:932.19

Purity: ≥95%

Appearance:White to Off-White Solid

* For research use only. Not for human or veterinary use.

Synonym

Synonyms[(2S,3E,5E,7E,9S,11R,13R,14R,15E,17R,20S,21R)-14,20-Dihydroxy-22-[(1S,3R,4R)-4-hydroxy-3-methoxycyclohexyl]-2,13-dimethoxy-3,9,11,15,17,21-hexamethyl-12,18-dioxo-3,5,7,15-docosatetraen-1-yl]tetrahydro-2-hydroxy-3-methyl-2H-pyran-2-yl]-2-oxoacetyl]-2-piperidinecarboxylic Acid; 34-Hydroxy Sirolimus; 34-Hydroxy Rapamycin

Property

Molecular Formula: C₅₁H₈₁NO₁₄
Molecular Weight932.19
SolubilityChloroform (Slightly), Methanol (Slightly)
Purity≥95%
Storage-20°C, Hygroscopic

Computed Descriptor

IUPAC Name(2S)-1-[2-[(2R,3R,6S)-6-[(2S,3E,5E,7E,9S,11R,13R,14R,15E,17R,20S,21R)-14,20-dihydroxy-22-[(1S,3R,4R)-4-hydroxy-3-methoxycyclohexyl]-2,13-dimethoxy-3,9,11,15,17,21-hexamethyl-12,18-dioxodocosa-3,5,7,15-tetraenyl]-2-hydroxy-3-methyloxan-2-yl]-2-oxoacetyl]piperidine-2-carboxylic acid
InChIInChI=1S/C51H81NO14/c1-30(24-34(5)45(56)47(65-10)46(57)35(6)25-32(3)41(54)29-42(55)33(4)26-37-20-22-40(53)44(27-37)64-9)16-12-11-13-17-31(2)43(63-8)28-38-21-19-36(7)51(62,66-38)48(58)49(59)52-23-15-14-18-39(52)50(60)61/h11-13,16-17,25,30,32-34,36-40,42-44,46-47,53,55,57,62H,14-15,18-24,26-29H2,1-10H3,(H,60,61)/b13-11+,16-12+,31-17+,35-25+/t30-,32-,33-,34-,36-,37+,38+,39+,40-,42+,43+,44-,46-,47+,51-/m1/s1
InChIKeyHAZKEXYMOCBCBG-HPLJOQBZSA-N
SMILESCC1CCC(OC1(C(=O)C(=O)N2CCCCC2C(=O)O)O)CC(C(=CC=CC=CC(C)CC(C)C(=O)C(C(C(=CC(C)C(=O)CC(C(C)CC3CCC(C(C3)OC)O)O)C)O)OC)C)OC