ID: 55063
SMILES:CC(=CCc1c(OC)ccc2c1OC(C)(C)C1CCC(C)=CC21)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.738
InChIKey:VHGPGKXCUQENEZ-UHFFFAOYSA-N
ID: 55064
SMILES:c1(CCCCC)c(C(=O)O)c(O)c(CC=C(C)CCC=C(C)C)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -18.085
InChIKey:UHPQVMVEJWPWDW-UHFFFAOYSA-N
ID: 55065
SMILES:c1(C2C(C(=C)C)C(c3cc(CCCCC)ccc3)C=C2O)cc(O)c(OC)cc1
Pathway: Polyketides;Shikimates and Phenylpropanoids;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.539
CB1 binding score: -15.374
InChIKey:JYVABKXYSSBBGZ-UHFFFAOYSA-N
ID: 55066
SMILES:O1c2c3c(cc(CCCCC)c2)OC(C)(C)C2C3(O)C(C)CCC2(O)C(C)C1=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -15.717
InChIKey:BFTPBXZGBPAPAJ-UHFFFAOYSA-N
ID: 55067
SMILES:C(c1c(O)c(CC=C(C)CCC=C(C)C)c(O)cc1CCC)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 316.441
CB1 binding score: -19.683
InChIKey:PLVFSLOPGLUASL-UHFFFAOYSA-N
ID: 55068
SMILES:C(C)CCCc1cc(O)c2c(c1)OC(C)(C)c1ccc(C)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 55069
SMILES:C1(C(C)CCC=C(C)C)CC=C(C)C12Oc1c(c(O)cc(C(CCCCC)=O)c1O)C2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -16.253
InChIKey:FSJUZISHCXYWLL-UHFFFAOYSA-N
ID: 55070
SMILES:CC(CCC=C(C)C)=CCc1c(O)cc(CCCCCO)cc1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -17.775
InChIKey:BPLYFGRGSWNQPD-UHFFFAOYSA-N
ID: 55071
SMILES:CC1=CC2C(CC1=O)C(C)(C)Oc1cc(C)c(O)cc12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Miscellaneous meroterpenoids
MW: 272.344
CB1 binding score: -17.952
InChIKey:CLFHOLPMPFYSHV-UHFFFAOYSA-N
ID: 55072
SMILES:C1(Cc2c(O)cc(CCCC)cc2O)CC(C)(C)CC1C(CCCO)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 362.554
CB1 binding score: -15.588
InChIKey:FEGODBDYYWYLMS-UHFFFAOYSA-N
ID: 55073
SMILES:O=C(c1c(CCC)cc2c(c1O)OC(C)(C)C1C2C=C(C(O)=O)CC1)C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.488
CB1 binding score: Not available
InChIKey:WBTCPLGDRYTEQN-UHFFFAOYSA-N
ID: 55074
SMILES:Oc1cc(O)cc2c1C1C(C(C)(C)O2)CC=C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 260.333
CB1 binding score: -18.561
InChIKey:RRHAEGQFRQNVHT-UHFFFAOYSA-N
ID: 55075
SMILES:C(CCC)Cc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)(O)C(O)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -17.774
InChIKey:GKYGKYSJIDSYCQ-UHFFFAOYSA-N
ID: 55076
SMILES:C(C)CCCCc1cc2c(c(O)c1)C1C(C(C)=C)(O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -15.537
InChIKey:XLVNLBSJRVILOZ-UHFFFAOYSA-N
ID: 55077
SMILES:C(CCC)Cc1cc2c(c(O)c1)C1C=C(CO)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -19.121
InChIKey:YCBKSSAWEUDACY-UHFFFAOYSA-N
ID: 55078
SMILES:C1C2(Oc3c1c(O)cc(CCCCC)c3)C(C)=CCC2C(C)CCC=C(CO)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -15.702
InChIKey:BVSZOMJZNJNOCT-UHFFFAOYSA-N
ID: 55079
SMILES:C1(=O)C(=CCCC(C)=CCc2c(O)ccc(O)c2)CC(C(C)(O)CCC=C(C)C)O1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 414.542
CB1 binding score: -15.396
InChIKey:PNSFZELUGQNWSL-UHFFFAOYSA-N
ID: 55080
SMILES:C(CCCc1cc2c(c(O)c1C=O)C1C3C(C)(O2)CCC=C(C)CCC=C(C)C13C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 422.609
CB1 binding score: -14.658
InChIKey:YRMAUBNPQXSDPJ-UHFFFAOYSA-N
ID: 55081
SMILES:c1(CC=C(C)CCC(O)C(C)=C)cc(O)c2c(c1)OC1(C)CC2C(O)C(C)(C)OC1=O
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 430.541
CB1 binding score: -11.779
InChIKey:PETOAFQXWQSHPO-UHFFFAOYSA-N
ID: 55082
SMILES:O1C2(CCC(C)C1)c1c(O)cc(CCCCC)cc1OC2(CCC=C(C)C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.576
CB1 binding score: -15.226
InChIKey:KGYVQJKVAPMZHJ-UHFFFAOYSA-N
ID: 55083
SMILES:C1(O)CCC2C(=O)C(c3c(O)cc(CCCCC)cc3O)OCC2C1=C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -15.308
InChIKey:QTVSWSUGUKNRGE-UHFFFAOYSA-N