ID: 65017
SMILES:CC(C=CCC(=CCc1cc(O)cc(C)c1O)C)=CCC=C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 326.48
CB1 binding score: -17.339
InChIKey:YJIJQYKRECIVSO-UHFFFAOYSA-N
ID: 65018
SMILES:C=C1C2C(c3c(cc(CCCCC)cc3OC)OC1C=C(C)C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -14.98
InChIKey:KWYVDZJVURXYRO-UHFFFAOYSA-N
ID: 65019
SMILES:CC1(CCC(=CCCC2(C)C=Cc3c(ccc(O)c3)O2)C)Oc2cc(C)ccc2C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 404.55
CB1 binding score: -16.124
InChIKey:XNMRTWXYGXLCQM-UHFFFAOYSA-N
ID: 65020
SMILES:C1CC2(C)Oc3c(c(O)cc(CCCCC)c3OC(C)=O)C(O)C2C(C)(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 390.52
CB1 binding score: -14.856
InChIKey:WNKSDCUGGFRVFP-UHFFFAOYSA-N
ID: 65021
SMILES:C(C(C(O)c1cc(O)c2c(c1)OC(C)(C)C1CC=C(C)C1C2)=O)CC(O)(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 388.504
CB1 binding score: -14.447
InChIKey:LSOXKOFVIMLKLZ-UHFFFAOYSA-N
ID: 65022
SMILES:C1(OCC)CC2(C)CCC(C(=C)C)C(C=O)C2Cc2c1cc(C(=O)c1cc(CCCCC)cc(O)c1)O2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 506.683
CB1 binding score: -15.681
InChIKey:XXYUNCUEWGBELW-UHFFFAOYSA-N
ID: 65023
SMILES:C1C(CCC(O)C(C)C)(C)Oc2cc(CCCCC=C)c(C(=O)O)cc21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -14.905
InChIKey:DSYATAALEHVVHG-UHFFFAOYSA-N
ID: 65024
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(O)(C)CO)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -16.211
InChIKey:IFVIOJVZRCYUQV-UHFFFAOYSA-N
ID: 65025
SMILES:Oc1cc2c(cc1CCCCC)OC(C)(C)C1CC(O)C(C)=CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.599
InChIKey:BCCTWXFPQLTOOX-UHFFFAOYSA-N
ID: 65026
SMILES:C=CCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.399
CB1 binding score: -18.957
InChIKey:MTBKFELEBUQONK-UHFFFAOYSA-N
ID: 65027
SMILES:Oc1c(C=O)c2c(c(O)c1)C1C(CCC(C)=C1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.343
CB1 binding score: -17.321
InChIKey:CMBFQSLUVVLKBC-UHFFFAOYSA-N
ID: 65028
SMILES:CC1=C(C2CC(C)=CCC3C(C)(C)Oc4cc(C)cc(O)c43)CCC2(C)C(C(C)=C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 434.664
CB1 binding score: -14.107
InChIKey:OZTBVBHJVRXFKJ-UHFFFAOYSA-N
ID: 65029
SMILES:O1C(C)CCC12C(C)(C)Oc1c2c(O)cc(CCCCC)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 304.43
CB1 binding score: -16.494
InChIKey:MNUYKWLUIJHNGG-UHFFFAOYSA-N
ID: 65030
SMILES:Oc1cc(CCCCC)cc2c1-c1c(ccc(C)c1)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 65031
SMILES:C12C(c3c(cc(CCCCC)cc3O)O1)C(C(C)C)C=CC2C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -5.374
InChIKey:LNBASIACLZXCLL-UHFFFAOYSA-N
ID: 65032
SMILES:C1(C)=CC2c3c(cc(CCCCC)c(C(O)=O)c3O)OC(CCC=C(C)C)(C)C2CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 426.597
CB1 binding score: -16.577
InChIKey:CRCVVYXKRNFYFQ-UHFFFAOYSA-N
ID: 65033
SMILES:C1C(CCCCC)=CC(=O)C2=C(C)CCC(C(C)=C)C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 272.432
CB1 binding score: -15.148
InChIKey:PVJIPDBOEVJRBA-UHFFFAOYSA-N
ID: 65034
SMILES:c12c(c(C(=O)C(CC)C)c(O)cc1C)OC(C)(C)C1CCC(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -15.369
InChIKey:DSYPTOQDBKAESM-UHFFFAOYSA-N
ID: 65035
SMILES:O(c1c(CC=C(C)CC(C=C(C)C)=O)cc(O)cc1CCCCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.495
CB1 binding score: -16.283
InChIKey:GKCUAHGLGNBIJM-UHFFFAOYSA-N
ID: 65036
SMILES:C1CC2(C)C3(c4c(cc(CCCCC)cc4O)OC(C)(C)C31)CCCC2=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 368.561
CB1 binding score: Not available
InChIKey:YVEZLVWFSZEIOY-UHFFFAOYSA-N
ID: 65037
SMILES:C(C=CC)=Cc1cc2c(c(O)c1)C1C(CC(O)C(C)(C)O1)C(C)(C)O2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 344.451
CB1 binding score: -13.207
InChIKey:KEZACYYGJUUXIW-UHFFFAOYSA-N