ID: 127891
SMILES:C1CC2(C)Oc3cc(C)cc(O)c3C2C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 230.307
CB1 binding score: -19.722
InChIKey:JTHBMMWBTWDAFK-UHFFFAOYSA-N
ID: 127892
SMILES:C12CCC(C)=CC1c1c(OC)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.348
InChIKey:FJRQDVCLUUZSIG-UHFFFAOYSA-N
ID: 127893
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2)C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -21.121
InChIKey:HCAWPGARWVBULJ-UHFFFAOYSA-N
ID: 127894
SMILES:Oc1c2c(cc(CCCCC)c1)C1C(C(CC=C(C)C)C=C1C)CC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.6
CB1 binding score: -13.445
InChIKey:FIMJKZOKZPBVCT-UHFFFAOYSA-N
ID: 127895
SMILES:Oc1cc(CCCCC)cc2c1C1C(C(C)(CCC=C(C)C)OC1=O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -14.821
InChIKey:YNKNWVODQSHUKT-UHFFFAOYSA-N
ID: 127896
SMILES:CC(CCC1C2(C)OC(C(C)(C)O1)CC2)(C)CCCC(C)=CCc1c(O)ccc(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.629
CB1 binding score: -14.049
InChIKey:VBOJDVGRFBHTRR-UHFFFAOYSA-N
ID: 127897
SMILES:c1(O)cc(CCCCC)cc2c1C1C(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: 127898
SMILES:C1(c2cc(CCCC(C)C)cc(O)c2)C=C(C)CCC1C(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.497
CB1 binding score: -17.265
InChIKey:CASHXEDGLRJCKM-UHFFFAOYSA-N
ID: 127899
SMILES:CC(C)=CC(CC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1C(=O)OC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -19.244
InChIKey:NBOVTDWILHORHD-UHFFFAOYSA-N
ID: 127900
SMILES:C1CC2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C2C(=C)CCC(O)C12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -18.127
InChIKey:JARYPHVMWNPTQA-UHFFFAOYSA-N
ID: 127901
SMILES:CC(CCC=C(C)C)(O)C1COc2c(cc(CCCCC)cc2O)C1O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -16.502
InChIKey:OXRICGRTVHJVNL-UHFFFAOYSA-N
ID: 127902
SMILES:C(c1cc(O)c(C2(C)CC(O)C(C(C)=C)O2)c(O)c1)C(C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 308.374
CB1 binding score: -10.094
InChIKey:BJKDZNDHPZWWJB-UHFFFAOYSA-N
ID: 127903
SMILES:C1C(C(=C)C)C(c2c(O)cc(CCCCC)cc2OC)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -17.696
InChIKey:HYNYRWBHLSVRRM-UHFFFAOYSA-N
ID: 127904
SMILES:C(CCCCCC)c1cc(O)c(C2C=C(C)CCC2C(C)=C)c2c1c1c([nH]2)c2c(c(O)c1)CCC(C)(CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 583.857
CB1 binding score: -13.94
InChIKey:YGYDIMJDTONPBY-UHFFFAOYSA-N
ID: 127905
SMILES:C1(C)(C)Oc2cc(CCCCC)cc(O)c2C2C1CC(O)C(=C)CCC=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.493
InChIKey:LNISQHKGHFSXKB-UHFFFAOYSA-N
ID: 127906
SMILES:c12cc(CCCCC)cc(O)c1C1C(C(C)(O)C)OCC(C)C1C(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.51
CB1 binding score: -14.056
InChIKey:PRHIVYYHJYQXEQ-UHFFFAOYSA-N
ID: 127907
SMILES:CC(C)(CC=O)c1cc(OC)c2c(c1)OC1(C)C(C2)C(C(C)=C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -15.114
InChIKey:LWBUZMAGAMWFTR-UHFFFAOYSA-N
ID: 127908
SMILES:c1(O)c2c(OC)cc(OC)c1C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.386
CB1 binding score: -15.988
InChIKey:BHHVYBXWLHCTND-UHFFFAOYSA-N
ID: 127909
SMILES:CCCC(=O)c1cc(C2C=C(C)CCC2C(C)=C)c(O)cc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -14.549
InChIKey:SWOHTDQFAAFHNZ-UHFFFAOYSA-N
ID: 127910
SMILES:CC(C)=CC(=O)CC(=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 330.468
CB1 binding score: -17.947
InChIKey:ZXDVFJZNEMZQLZ-UHFFFAOYSA-N
ID: 127911
SMILES:OCCc1cc(O)c2c(c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.387
CB1 binding score: -18.582
InChIKey:PDYKIGRVNVKGPA-UHFFFAOYSA-N