ID: 15751
SMILES:c1(CCCCC)c2c(c(O)cc1Cl)CC(C(=C)C)C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 322.876
CB1 binding score: -13.283
InChIKey:SHHUVHFWAQYJLF-UHFFFAOYSA-N
ID: 15752
SMILES:C(CCCCCC=CCCc1c(O)c2c(c(C=O)c1O)OC(C)(C)C1CC=C(C)C(O)C21)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 456.623
CB1 binding score: -10.088
InChIKey:GJIDVQBBSSBFLC-UHFFFAOYSA-N
ID: 15753
SMILES:C1(=O)Oc2cc(CCCCC)cc(O)c2C2CC(C)=CCC12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -16.174
InChIKey:XKPNOYNMDPEKLR-UHFFFAOYSA-N
ID: 15754
SMILES:CCCc1cc2c(c(O)c1)C1CC(C)CCC1C(C)(C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 288.431
CB1 binding score: -18.987
InChIKey:QYNCMPYNYFYQFE-UHFFFAOYSA-N
ID: 15755
SMILES:CC1(C)Oc2c(c(O)c(CC=C(C)C)c(OC3C=C(C)CCC3C(C)=C)c2)C=C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 394.555
CB1 binding score: -15.815
InChIKey:LRWFVSGXURCTOH-UHFFFAOYSA-N
ID: 15756
SMILES:C(Cc1cc(O)c2c(c1)OC(C)(C)C1CC(=O)C(C)=CC21)CC(=O)OCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.461
CB1 binding score: -15.673
InChIKey:ZODXEPMSMULBKW-UHFFFAOYSA-N
ID: 15757
SMILES:O=S(O)(=O)Oc1c2c(cc(CCCC)c1O)OC(C)(CCC=C(C)CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 464.624
CB1 binding score: -15.095
InChIKey:AFRQWUWGXZAZPY-UHFFFAOYSA-N
ID: 15758
SMILES:O1c2cc(CCCCC)c(O)cc2C2CC(C)=C(C)C12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -16.346
InChIKey:PBBPASHRDMABOW-UHFFFAOYSA-N
ID: 15759
SMILES:O1C2CC(OC)C(C)(C(O)C2C)C1(c1c(O)c(CCCCC)cc(OC)c1)C
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 392.536
CB1 binding score: -15.019
InChIKey:PTUHRHXYPKYDPH-UHFFFAOYSA-N
ID: 15760
SMILES:c12c(O)cc(CCCCC)cc1OC(C)(CCC=C(C)C)C=C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 15761
SMILES:c1(CCc2ccccc2)ccc2c(c1)OC(C)(C)C1CC=C(C)CC12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.487
CB1 binding score: -15.019
InChIKey:YYMWYOFLEGGBEQ-UHFFFAOYSA-N
ID: 15762
SMILES:c1(CCCCC)cc2c(c(O)c1C1=CC(=O)CC(C)O1)C=CC(C)(CCC=C(C)CCC=C(C)C)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 492.7
CB1 binding score: -14.919
InChIKey:RETHWIIYDCESBQ-UHFFFAOYSA-N
ID: 15763
SMILES:C1=C(C)C2C(C)(CC1)C(O)C(c1c(O)cc(CCCC)cc1O)(O)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.021
InChIKey:HHFOVGUXDTWZON-UHFFFAOYSA-N
ID: 15764
SMILES:C(C=C)=CC1OC1CC(C)=CCc1c(O)c(C)cc(O)c1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.371
CB1 binding score: -15.58
InChIKey:TTYDPFMVTUBFJN-UHFFFAOYSA-N
ID: 15765
SMILES:c12c(cc(CCC)cc1O)OC(C)(C)C1CC=C(C)CC21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 286.415
CB1 binding score: -19.805
InChIKey:CDBDULHNWQRYSY-UHFFFAOYSA-N
ID: 15766
SMILES:CCCCCc1cc2c(cc1C)OC(C)(C)C1=C2C(O)C(C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -12.922
InChIKey:UPOYGHSUGMNNIV-UHFFFAOYSA-N
ID: 15767
SMILES:C1(=O)C=C(C)C2(Oc3c(c(O)cc(CCCCC)c3)C2C=C(C)C)CC1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.489
CB1 binding score: -16.03
InChIKey:PKOXIWZMDNBVPV-UHFFFAOYSA-N
ID: 15768
SMILES:C12C(C)(C3CC(=O)C4(C)Oc5c(c(cc(CCCCC)c5)O4)C3C(O)(C)CC1)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.515
CB1 binding score: -13.621
InChIKey:FZTIFYSMJVCCKJ-UHFFFAOYSA-N
ID: 15769
SMILES:C1(C)(C)C2C(c3c(O)cc(CCCC)c(O)c31)CC(C)=CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -16.275
InChIKey:AGHKPVZFWRFWHX-UHFFFAOYSA-N
ID: 15770
SMILES:C(=O)C1=CCC2C(C)(C)Oc3c(c(O)cc(CCCCC)c3)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -18.255
InChIKey:BGIBNWZALWRTHR-UHFFFAOYSA-N
ID: 15771
SMILES:C1Cc2c(O)cc(CCCCC)cc2OC1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 248.366
CB1 binding score: -19.22
InChIKey:AHKIGVNVQSVNEP-UHFFFAOYSA-N