ID: 45970
SMILES:C(CCC)Cc1cc(O)c(C2C(C(C)C)CCC(C)=C2)c(O)c1CC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 384.604
CB1 binding score: -16.641
InChIKey:ZDFUFEGSMPMHCB-UHFFFAOYSA-N
ID: 45971
SMILES:CC1=NC2Oc3c(c(O)cc(CC=C)c3)C(CO)C2CC(O)C(C)(C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 361.438
CB1 binding score: -16.32
InChIKey:GRWLAIJHRFNSET-UHFFFAOYSA-N
ID: 45972
SMILES:C12(C)C(CCC(=CC3c4c(cc(CCCCC)cc4O)O3)C(C)(O)CC(O)C1=O)C(=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.661
CB1 binding score: -15.016
InChIKey:BJMFMLAMLOBNJB-UHFFFAOYSA-N
ID: 45973
SMILES:C(=CC)(C(=O)OC(C(C)C)c1c2c(c(OC)cc1C)OC(C)(C)C1C2CC(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.613
CB1 binding score: -17.31
InChIKey:YYXTXQWVQKFLNF-UHFFFAOYSA-N
ID: 45974
SMILES:C1(Br)C(C)(C)Oc2c(c(O)cc(CCCCC)c2Cl)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 361.707
CB1 binding score: -12.176
InChIKey:RXGIJYZYEUSFEV-UHFFFAOYSA-N
ID: 45975
SMILES:C1=CCC(C)c2c(C)c3c(cc21)C(C)(C)Oc1cc(CCCCC)cc(OC)c13
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.567
CB1 binding score: -14.94
InChIKey:UTDJQJOZICCWQK-UHFFFAOYSA-N
ID: 45976
SMILES:C1=C(C(O)=O)CCC(O)C(C)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.439
CB1 binding score: -14.342
InChIKey:SYDFJHVOCCBXQP-UHFFFAOYSA-N
ID: 45977
SMILES:c12c(cc(CCCCC)cc1O)OC(C)(C)C1CCC(C)(OC)C21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -16.791
InChIKey:MTXBVBCSVMSZFL-UHFFFAOYSA-N
ID: 45978
SMILES:c1(CCCCCC)c2c(c3c(c1O)C(=O)C1(C(C(C)(C)O)C3C=C(C)CC1)C(C)(C)O2)C(C)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 482.705
CB1 binding score: -15.135
InChIKey:DBLNMIHTAZPBNV-UHFFFAOYSA-N
ID: 45979
SMILES:Oc1c(C(CC(C)C)=O)c2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -17.385
InChIKey:KCKFCLWTUCSIQS-UHFFFAOYSA-N
ID: 45980
SMILES:c1c(CCCCC)cc(O)c(C2C=C(CCC=C(C)C)CCC2OC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.55
CB1 binding score: -13.412
InChIKey:GWAVTGLGLDJMSJ-UHFFFAOYSA-N
ID: 45981
SMILES:C1(C)=CC2C(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 45982
SMILES:CC(C1C(c2c(-c3ccccc3)c(CCCCC)ccc2)C=C(C)CC1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.585
CB1 binding score: -13.839
InChIKey:MDTYESRQVTWROX-UHFFFAOYSA-N
ID: 45983
SMILES:C1C(C(=C)C)C(c2c(O)cc(C)cc2O)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.979
InChIKey:GKVOVXWEBSQJPA-UHFFFAOYSA-N
ID: 45984
SMILES:Oc1cc(CCCC)c2c(c1)C1CC(C(C)CCC=C(C)C)=CCC1(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -13.848
InChIKey:IFCJEXSEAFHHSR-UHFFFAOYSA-N
ID: 45985
SMILES:C(C)(C)=CCCC(=CCc1c(OC)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.512
CB1 binding score: -19.49
InChIKey:KASVLYINZPAMNS-UHFFFAOYSA-N
ID: 45986
SMILES:C1CC2C(CC=C(C)C1)C(C)(C)Oc1c2cccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.389
CB1 binding score: -14.506
InChIKey:SBGNCZVHHQBDFY-UHFFFAOYSA-N
ID: 45987
SMILES:Oc1cc(CCCC)cc2c1C1C(CCC(COC(C)=O)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -17.499
InChIKey:ZEQOYYZVFGLRBF-UHFFFAOYSA-N
ID: 45988
SMILES:C1(C)=CCCC(=C)C=Cc2c(ccc(CCCCC)c2)OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.508
CB1 binding score: -17.073
InChIKey:XSUCMULZJSKWEK-UHFFFAOYSA-N
ID: 45989
SMILES:C1=C2C(O)=C(C(=O)CC(C)C)C(=COc3c(CO)cc(O)c4c3CC(C)=CCC14)CC(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 466.574
CB1 binding score: -14.342
InChIKey:BTYZKHBLBOICSY-UHFFFAOYSA-N
ID: 45990
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C3CCC(C)C13O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.328
InChIKey:ZCULVOWIFMMCGW-UHFFFAOYSA-N