ID: 71758
SMILES:OC1C2(C=CC3C(C)(C)Oc4c(cc(CCCCC)c(C(=O)O)c4O3)C2)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -14.365
InChIKey:HKRVCBQHLIGWKI-UHFFFAOYSA-N
ID: 71759
SMILES:C(C)(CCC=C(C)C)=CCCC1(C)Oc2cc(CCCCC)c(C(=O)O)cc2C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -14.268
InChIKey:ZDUVMSWRHKLRNX-UHFFFAOYSA-N
ID: 71760
SMILES:O(c1ccc2c(c1)OC(C)(C)C1C2C=C(C)CC1)CC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.388
CB1 binding score: -16.894
InChIKey:FSSDNYBXAJPPFN-UHFFFAOYSA-N
ID: 71761
SMILES:c1cc(CC=C)c(O)c2c1OC(C)(C)C1C2CC(C)=CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -16.376
InChIKey:HBOUEPXBJVNCSM-UHFFFAOYSA-N
ID: 71762
SMILES:C12(C)C(O)(C=C3C(COc4cc(CCCCC)cc(O)c41)O3)C(O)(C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.585
CB1 binding score: -16.068
InChIKey:JQMQBVDREHYGDG-UHFFFAOYSA-N
ID: 71763
SMILES:CN(C)CCc1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C1C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 315.457
CB1 binding score: -12.34
InChIKey:HVKAKYCZLAPLIM-UHFFFAOYSA-N
ID: 71764
SMILES:c1(O)c2c(cc(CCCCC)c1)OC(C)(CCC=C(C)C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -19.791
InChIKey:ORKZJYDOERTGKY-UHFFFAOYSA-N
ID: 71765
SMILES:C1(=O)C2C(O)(C(C)(C)Oc3c2c(O)cc(CCCCC)c3)CC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -16.438
InChIKey:ZFKZDTFRFHNXNF-UHFFFAOYSA-N
ID: 71766
SMILES:CC1(C)C2=C(CC3C1(C)C(C)CC3)c1c(O)cc(CCCCC)cc1OC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: -14.605
InChIKey:KCQLHGQFTFMTQL-UHFFFAOYSA-N
ID: 71767
SMILES:c12c(cc(CCCCC)cc1O)OC1(C2)C2(C)C(C=CC1=O)C(C)(C)CCC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.544
CB1 binding score: -15.242
InChIKey:GSUXNCCBYWPHOP-UHFFFAOYSA-N
ID: 71768
SMILES:C1(CC=CC(C)(C)O)(C)Oc2cc(CCCCC)cc(O)c2C(=O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -15.047
InChIKey:JJXCKHZFVGKUFZ-UHFFFAOYSA-N
ID: 71769
SMILES:c1(CCCCC)cc2c(c(O)c1)C(C)CC(O)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 250.338
CB1 binding score: -15.786
InChIKey:VJUMZPIIIKSIPW-UHFFFAOYSA-N
ID: 71770
SMILES:C(CC(C)(C)O)C(=O)C(C)=CCc1c(O)cc(CCCCC)cc1OC(C)=O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -15.398
InChIKey:JDGBMAKRNMRXMH-UHFFFAOYSA-N
ID: 71771
SMILES:C1CC2(C)OC1C1C2C(C=CC=O)(C)CC(c2c(O)cc(CCCCC)cc2OC)O1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -17.021
InChIKey:CBMUUHWYSJSDIJ-UHFFFAOYSA-N
ID: 71772
SMILES:OC1CC=C(C)COc2ccc(CCCCCC)cc21
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -14.641
InChIKey:IQYDACKGLVFADF-UHFFFAOYSA-N
ID: 71773
SMILES:C1(C(C)=C)CCC(C)=CC1c1c(O)cc(CCCCC)cc1OC(C)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 356.506
CB1 binding score: -17.989
InChIKey:ZTZGBEZKXBIYDU-UHFFFAOYSA-N
ID: 71774
SMILES:c1(CCc2cc(O)cc(OC)c2)cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids;Stilbenoids
Class: Cannabinoids;Monomeric stilbenes
MW: 394.511
CB1 binding score: -16.015
InChIKey:OAHLIAKQKYZRNS-UHFFFAOYSA-N
ID: 71775
SMILES:C12C(c3c(c(OC)cc(CCCCC)c3)C1O)OC2(C(O)(C)CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.575
CB1 binding score: -14.413
InChIKey:BKTUDPAGIDTSLF-UHFFFAOYSA-N
ID: 71776
SMILES:C1(C)=CC2C3(O)C4(C(C)CC(C(C)=C3O)C4(CC=CC(O)(C)C)OC2=O)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: -15.763
InChIKey:LLMDUDHHZWTKNI-UHFFFAOYSA-N
ID: 71777
SMILES:CC12CCC3C(C)(C)Oc4c(cc(CCCCO)cc4OC1)C2CC3
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: Not available
InChIKey:NRCCHTUDMVUZAP-UHFFFAOYSA-N
ID: 71778
SMILES:CC1(C)Oc2c(c(O)cc(CCCCC)c2O)C2C=C(C)CCC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -18.349
InChIKey:PVWKYDHSQZSCHQ-UHFFFAOYSA-N