ID: 87550
SMILES:C(CCC)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.175
InChIKey:RVWTXSLOGRTPEH-UHFFFAOYSA-N
ID: 87551
SMILES:C(Cc1cc(O)c2c(c1)OC1(C)CC2C(C(=C)C)CC1)(C)CCC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -15.887
InChIKey:DBTOPASZNCKENN-UHFFFAOYSA-N
ID: 87552
SMILES:CC1(C)CC2c3c(O)cc(CCCCC)cc3OC3(C)CC=CC(C)(CC1)C23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -15.552
InChIKey:HKSMRQKRAZHVPZ-UHFFFAOYSA-N
ID: 87553
SMILES:C(CCCC)c1cc2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 87554
SMILES:C=C(C)C1C(c2c(O)cc(CCCC)cc2O)C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -19.739
InChIKey:WBRXESQKGXYDOL-UHFFFAOYSA-N
ID: 87555
SMILES:C1(C(C)C)C=CC2(C)Oc3c(c(OC)cc(CCCCC)c3)CC2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.523
CB1 binding score: -14.815
InChIKey:WVNXAOWOAXRVRM-UHFFFAOYSA-N
ID: 87556
SMILES:C1C2C(C)(C)Oc3cc(CCCC)cc(O)c3C2C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -20.843
InChIKey:QHCQSGYWGBDSIY-UHFFFAOYSA-N
ID: 87557
SMILES:C(C)(O)(CCCC(C)C(O)=C)c1c(O)cc(O)c2c1OC(C)(C)C1CCC(C)=CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.558
CB1 binding score: -13.928
InChIKey:BUKIBEKGKDKGRS-UHFFFAOYSA-N
ID: 87558
SMILES:C1(C)=CC2c3c(cc(CCCCC)cc3O)OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 87559
SMILES:C1C(O)C(C)C2C(=C1)C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -17.17
InChIKey:BLXLBPGZJVAVQL-UHFFFAOYSA-N
ID: 87560
SMILES:C(CCCc1cc2c(c(C(O)C=CC(O)(C)C)c1O)OC(C)(C)C1=C2CC(C)CC1)C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.667
CB1 binding score: -17.483
InChIKey:ZMOPKQIBSTXWBO-UHFFFAOYSA-N
ID: 87561
SMILES:c12c(cccc1CCCCC)OC(C)(C)C1C2CC(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.486
CB1 binding score: -17.344
InChIKey:ZZDNJFKLSTXKOY-UHFFFAOYSA-N
ID: 87562
SMILES:c1(O)c(=O)c(O)cc2c(c1CCCC)OC(CC=C(C)C)C(=C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.424
CB1 binding score: -14.284
InChIKey:LWNKKQPJBUQQOL-UHFFFAOYSA-N
ID: 87563
SMILES:CC1(C)Oc2c(cc(CCC(O)(C)C)c(O)c2)C2C1CCC(C)=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -15.733
InChIKey:NXLRUUVDBGVUFQ-UHFFFAOYSA-N
ID: 87564
SMILES:C1(=O)C=C(NCC(C)C)C(=O)C(CCC2(C)C(C)CCC3(C)C(=C)CCCC3=C)=C1O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 425.613
CB1 binding score: -14.309
InChIKey:HIWVJRVMZSPLLK-UHFFFAOYSA-N
ID: 87565
SMILES:C(CCC)c1ccc2c(c1O)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -15.983
InChIKey:WYVAXWIQXWGBJO-UHFFFAOYSA-N
ID: 87566
SMILES:C(C)CCCCc1cc(O)c2c(c1)OC(C)(C)C1CCC(C=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -17.687
InChIKey:WUKPITZIDDNGJC-UHFFFAOYSA-N
ID: 87567
SMILES:C1C(C(C)C)C(c2c(O)ccc(CCCCC)c2)C=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids;Sesquiterpenoids
Class: Cadinane sesquiterpenoids;Cannabinoids
MW: 300.486
CB1 binding score: -18.255
InChIKey:FVMNSBXLYRKHTD-UHFFFAOYSA-N
ID: 87568
SMILES:O=C(OC)CCc1cc2c(c(O)c1)C1C(C(C)(C)O2)CC(OC)C(CCC=C(C)C)(C)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 446.584
CB1 binding score: -15.194
InChIKey:ISPRXDFZZFBCOO-UHFFFAOYSA-N
ID: 87569
SMILES:CC(=CCc1c(O)cc(CCCCC)cc1O)CCC=C(C)CCC(C(O)(C)C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.602
CB1 binding score: -16.771
InChIKey:VQLNTRFCJZFGDJ-UHFFFAOYSA-N
ID: 87570
SMILES:CC1(CCC=C(C)C)C=Cc2c(O)cc(CCCCC)cc2O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N