ID: 79087
SMILES:C1C(O)C(C)=C2c3c(O)cc(CCCCC)cc3OC(C)(C)C12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.441
CB1 binding score: -17.197
InChIKey:OFQHNOYVCVEEMU-UHFFFAOYSA-N
ID: 79088
SMILES:C1(C)CC2c3c(O)cc(CC)cc3OC(C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -18.253
InChIKey:YQZKSASIODXUPT-UHFFFAOYSA-N
ID: 79089
SMILES:C(C)(=C)C1C2(C(C)=CC1)c1c(cc(CC)cc1O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 256.345
CB1 binding score: -15.242
InChIKey:WBWZYDRJISUWRR-UHFFFAOYSA-N
ID: 79090
SMILES:CC(=CCCC1(C)Oc2c(c(O)cc(CCCCC)c2)C=C1)CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 382.588
CB1 binding score: -19.944
InChIKey:PXPDKUHGJIMKBA-UHFFFAOYSA-N
ID: 79091
SMILES:C12c3c(cc(CCCCC)cc3O)OC(C)(C)C1CCC(C)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 79092
SMILES:C(C1(c2oc(C=O)cc2CCCC)CC(C)=CC(=O)C1)CC=C(C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 342.479
CB1 binding score: -16.16
InChIKey:ALZXDYPJJVOHOP-UHFFFAOYSA-N
ID: 79093
SMILES:CC1(C)Oc2cc(O)cc(CCCCC)c2C(C(=O)C=CC)C1O
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.44
CB1 binding score: -15.293
InChIKey:UBKHOYMDDYOLBW-UHFFFAOYSA-N
ID: 79094
SMILES:C1C(C)(CCCC(CCCC(C=C2OC(=O)C(C)=C2)=C)C)Oc2c1c(O)cc(C)c2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.554
CB1 binding score: -14.673
InChIKey:SEICEEQSQMCFBU-UHFFFAOYSA-N
ID: 79095
SMILES:C(C(CO)O)(OC)c1c(O)c2c(cc1C)OC(C)(C)C1CCC(C(O)=O)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.448
CB1 binding score: -16.434
InChIKey:ZNYPIYAHBMEHNS-UHFFFAOYSA-N
ID: 79096
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(=C)C)CC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 296.454
CB1 binding score: -16.885
InChIKey:ZGTZBRKFZJGQFD-UHFFFAOYSA-N
ID: 79097
SMILES:CC(C)=CCCC(C)=CCCC(C)=CCc1c(O)c(C(=O)O)c(CCC)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 400.559
CB1 binding score: -18.074
InChIKey:XJNWDFKQIJOXOC-UHFFFAOYSA-N
ID: 79098
SMILES:O1c2c(cc(CCCCC)cc2O)C2C1(C)CCCC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -19.744
InChIKey:FIVCBXZZBODZRA-UHFFFAOYSA-N
ID: 79099
SMILES:C(CCC)c1ccc(=O)c2c(c1)C1C=C(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -15.369
InChIKey:IYUOBLIAAHSRNV-UHFFFAOYSA-N
ID: 79100
SMILES:C(c1c(O)c(CCC(=CCC=C(C)C)C)c2c(c1)OC(C)(C)C1CC=C(C)C(O)C21)C=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.69
CB1 binding score: -15.962
InChIKey:XLRSZDDOPZENFG-UHFFFAOYSA-N
ID: 79101
SMILES:C1C2C(C)(C)Oc3cc(CCCCC)cc(O)c3C2C(C)C(O)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -17.616
InChIKey:XGSKNUGSVQOZFI-UHFFFAOYSA-N
ID: 79102
SMILES:CC1=CC2C(CC1)C(C)(C)Oc1c2c(O)cc2c1CN(CCc1ccccc1)C2=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 403.522
CB1 binding score: -16.724
InChIKey:RIPYIFGXLXKJGD-UHFFFAOYSA-N
ID: 79103
SMILES:c1(S(=O)(=O)O)cc(CCCCC)c(C(=O)O)c2c1OC(C)(C)C1CCC(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.543
CB1 binding score: -15.341
InChIKey:KKWUZKMCMVAWKK-UHFFFAOYSA-N
ID: 79104
SMILES:Oc1c2c(cc(CCCCC)c1)OC(C)(C)C1C2C=C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 79105
SMILES:C(CCCC)c1cc2c(cc1CC=C(C)C)OC(C)CC2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.459
CB1 binding score: -16.246
InChIKey:XUHNMHMUTXZEAB-UHFFFAOYSA-N
ID: 79106
SMILES:C(C)(C1Oc2c(c(OC)cc(CCCC)c2)C2C=C(C(O)CC=C(C)C)C(=O)OC12)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 428.569
CB1 binding score: -14.753
InChIKey:BEFAPIOHFQMSAF-UHFFFAOYSA-N
ID: 79107
SMILES:CC1(CCOC)C(c2c(O)cc(CCCCC)cc2O)C=C(C)CCC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.538
CB1 binding score: -15.47
InChIKey:ZNUGDRNTNBTRMD-UHFFFAOYSA-N