ID: 42211
SMILES:COc1cc(O)cc2c1C1CC(=C)CCC1C(C)(C)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.36
CB1 binding score: -15.818
InChIKey:VJOFYHQBFFXBCF-UHFFFAOYSA-N
ID: 42212
SMILES:C(C)CCCc1cc2c(c(O)c1)C1CC(=C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.055
InChIKey:AOYYFUGUUIRBML-UHFFFAOYSA-N
ID: 42213
SMILES:C(C)(C)=CCCC(=CCc1c(C(OC)=O)cc(CCCCC)c(C2C(C(C)=C)CCC(C)=C2)c1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.744
CB1 binding score: -15.588
InChIKey:QGOUZHWXESBARE-UHFFFAOYSA-N
ID: 42214
SMILES:C(O)(C)(C1C(c2c(O)cc(CCCC)cc2O)C=C(CO)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -15.456
InChIKey:VXHPGPNMJDEFGI-UHFFFAOYSA-N
ID: 42215
SMILES:C(CC)Cc1cc2c(c(O)c1)C1CC(C)CC(=O)C1=C(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 298.426
CB1 binding score: -15.346
InChIKey:IVCVNDLQCZCBGW-UHFFFAOYSA-N
ID: 42216
SMILES:c1(CCCCC)cc2c(c(O)c1)C(O)C1C(=O)C23CC(C1(C)C)O3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -12.323
InChIKey:HMFWTKUMCHWTDJ-UHFFFAOYSA-N
ID: 42217
SMILES:C(c1c(COC(C)=O)c(C=O)c(O)c(C2C=C(C)CCC2C(C)=C)c1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.418
CB1 binding score: -13.422
InChIKey:IQIVJAOZRIWYRU-UHFFFAOYSA-N
ID: 42218
SMILES:C1=C(C)C2C(C(C)(C)Oc3c(c(OC)c4c(O)cccc4c3)C2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 324.42
CB1 binding score: -14.186
InChIKey:FYDBQMMSKDKPIS-UHFFFAOYSA-N
ID: 42219
SMILES:C1(C(C)(C)OC)=Cc2c(c(O)cc(CCCCC)c2)C2CC(C)=CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 354.534
CB1 binding score: -16.462
InChIKey:JJQSWPLSAMDELC-UHFFFAOYSA-N
ID: 42220
SMILES:O1c2cc(CCCCC)ccc2C2C(C(=C)CO)CCC(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -15.12
InChIKey:BPLDOVQZACGTHV-UHFFFAOYSA-N
ID: 42221
SMILES:CC(=C(C)C)C1C(c2c(O)cc(CCCCC)cc2O)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -15.339
InChIKey:AQEDNKNEJSQWSY-UHFFFAOYSA-N
ID: 42222
SMILES:C(C1=CC2C(C(C)(C)Oc3cc(CCCCC)cc(O)c32)CC1)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -19.053
InChIKey:HQRKNUDGMPVIMO-UHFFFAOYSA-N
ID: 42223
SMILES:CC1=CC(c2c(O)cc(CCCCC)c(C(O)=O)c2OC)CC(C)=CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -15.397
InChIKey:VYSYKMIHCNPGHS-UHFFFAOYSA-N
ID: 42224
SMILES:CC1(C)C2=C(c3c(cc(CCCCC)cc3O)OC2O)C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -16.502
InChIKey:DRJWNVGHRRULIL-UHFFFAOYSA-N
ID: 42225
SMILES:C(C1C(C)(C)Oc2cc(CCCCC)cc(O)c21)=CC(C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.88
InChIKey:OFRIDUMGWABNQT-UHFFFAOYSA-N
ID: 42226
SMILES:O(CC(c1c(O)c(O)c2c(c1)OC(C)(C)C1CCC(CO)=CC21)=O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.395
CB1 binding score: -14.801
InChIKey:CHEKHOPTHWKTEJ-UHFFFAOYSA-N
ID: 42227
SMILES:Cc1ccc(C(C)(C)C=CCC2(C)C3C(=CC(C)=CC(O)CC(C)=CC2)O3)c(O)c1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 408.582
CB1 binding score: -12.543
InChIKey:RZYOQBFIESMWEO-UHFFFAOYSA-N
ID: 42228
SMILES:C1(C)=CC2C(C(C)(C)Oc3cc(CCCCC)c(C(=O)O)c(O)c32)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.478
CB1 binding score: -19.351
InChIKey:UCONUSSAWGCZMV-UHFFFAOYSA-N
ID: 42229
SMILES:C(CCC)Cc1cc2c(c(O)c1)C(=O)C(CC=C(C)C)=C(O)C2(CC=C(C)C)O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -14.239
InChIKey:ACQXUBGFNFKLSP-UHFFFAOYSA-N
ID: 42230
SMILES:C12Cc3c(c(O)cc(CCCCCO)c3)OC(C)(C)C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -13.521
InChIKey:FHEOQZFCTNVMTF-UHFFFAOYSA-N
ID: 42231
SMILES:Cc1cc(O)c2c3c1OC(C)(C)C1C3C(C=C2)C(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 270.372
CB1 binding score: -12.41
InChIKey:ITUYURIRITWDIA-UHFFFAOYSA-N