ID: 125413
SMILES:C1(C)CCC(C(=C)C)C(c2c(OC)cc(OC)cc2CCCCC)C1C(C)(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.619
CB1 binding score: -15.009
InChIKey:YKBXYGZMKSUTCA-UHFFFAOYSA-N
ID: 125414
SMILES:Oc1cc(CCC)cc2c1C1C(CC(O)C(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.414
CB1 binding score: -19.829
InChIKey:JXXVDKGGZIPBOC-UHFFFAOYSA-N
ID: 125415
SMILES:C1(Cl)CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2CC1(O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 366.929
CB1 binding score: -15.625
InChIKey:JVDPMMNQSYKJOP-UHFFFAOYSA-N
ID: 125416
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 125417
SMILES:O1c2cc(C)cc(O)c2C2C=C(C)CCC2C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 244.334
CB1 binding score: -17.527
InChIKey:FMJNAKPTTHESLW-UHFFFAOYSA-N
ID: 125418
SMILES:Brc1ccc2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 307.231
CB1 binding score: -18.101
InChIKey:NUFAWTFHHNIXAW-UHFFFAOYSA-N
ID: 125419
SMILES:c1ccc(CCCNO)cc1C1C(C(C)=C)CC=C(C)C1CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 353.55
CB1 binding score: -14.973
InChIKey:GMFGGKILDCVMEW-UHFFFAOYSA-N
ID: 125420
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 125421
SMILES:c1(O)cc(C)cc(C2C(C(=C)C)CCC(C)=C2)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 242.362
CB1 binding score: -17.706
InChIKey:FBXSVXARSUKKDJ-UHFFFAOYSA-N
ID: 125422
SMILES:C1C2(C)Oc3c(c(O)cc(C)c3)C3C2C2C(C(C)=C)C1(C)C3=C(O)C(=O)C2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 380.484
CB1 binding score: -14.659
InChIKey:TZYNUQWYPRZHHJ-UHFFFAOYSA-N
ID: 125423
SMILES:C1C(C)(C)C2c3c(O)cc(CCCCC)cc3OC2(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -18.528
InChIKey:RUNFDTKOHGWARR-UHFFFAOYSA-N
ID: 125424
SMILES:C1(C)=CC(c2c(O)cc(O)cc2CCCCC)C(C(C)=C)CC1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.103
InChIKey:GKUYOVLSFFJLNQ-UHFFFAOYSA-N
ID: 125425
SMILES:CC(C)C=C(c1cc(O)c2c(c1)OC(C)(C)C1CCC(C)=CC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -12.484
InChIKey:IZZYDDYJTJBKPV-UHFFFAOYSA-N
ID: 125426
SMILES:C=C(C)C1Cc2c(O)cc(CCC)cc2OC1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 246.35
CB1 binding score: -14.665
InChIKey:AYAAZKLHRUGDED-UHFFFAOYSA-N
ID: 125427
SMILES:c1c(O)c2c(cc1CCCCC)cc(OC)c1c2OC(C)(C)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.249
InChIKey:MPSPOYRHUUMXIP-UHFFFAOYSA-N
ID: 125428
SMILES:Oc1cc(CCCCC)cc2c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 125429
SMILES:Oc1cc2c(cc1Br)OC(C)(C)C1CCC(C)=CC21
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 323.23
CB1 binding score: -18.306
InChIKey:HTFNXHQGRQXUTG-UHFFFAOYSA-N
ID: 125430
SMILES:C1C(C(C)C)C(O)(c2c(O)cc(CCCCC)cc2OC)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.511
CB1 binding score: -12.656
InChIKey:KJJKJFBTDOVHSU-UHFFFAOYSA-N
ID: 125431
SMILES:O1C(C)(C)C2C(CC(C)=C1)c1c(cc(CCCCC)cc1OC(=O)C)c(OC)c2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -14.966
InChIKey:RRPMKAZXLITWBF-UHFFFAOYSA-N
ID: 125432
SMILES:O1c2cc(CCCC)cc(c2)CC(C(=C)CCC=C(C)C)C=C1COC(C)=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.114
InChIKey:ASRKCWHVFKNUNU-UHFFFAOYSA-N
ID: 125433
SMILES:C1C2C(C)CCC(C(C)(O)C)C2c2c(cc(C)cc2O)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 290.403
CB1 binding score: -15.843
InChIKey:NZXPDWSEMXOZPY-UHFFFAOYSA-N