ID: 76714
SMILES:C1(C(=C)C)CC(CCC(=O)OC)(C)Oc2cc(CCCCC)cc(O)c21
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.494
CB1 binding score: -16.571
InChIKey:ABLXHMWPZHZXHD-UHFFFAOYSA-N
ID: 76715
SMILES:O1C2(Cc3c(O)cc(CCCCC)cc31)C(C)CCC1C(C)(C)C3CC(O1)OC23
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -15.213
InChIKey:ZRVBVJLSKZOAQK-UHFFFAOYSA-N
ID: 76716
SMILES:C(CC)(C(=O)c1c2c(cc(O)c1)OC(C)(C)C1C2C=C(C)CC1)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -15.76
InChIKey:MAOFBSSFRYPCSO-UHFFFAOYSA-N
ID: 76717
SMILES:C1(=O)CCC2=Cc3c(cc(CCCCC)cc3O)OC(C)(C)C2C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.217
InChIKey:KWCOYQYDPNYARS-UHFFFAOYSA-N
ID: 76718
SMILES:c12c(c(O)cc(CCCCC)c1)-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: 76719
SMILES:c1c(CCCCC)cc2c(c1O)C1C(C(C)(C)O2)CCC(C)=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.604
InChIKey:CYQFCXCEBYINGO-UHFFFAOYSA-N
ID: 76720
SMILES:C12C(c3c(O)cc(CCCC)cc3O1)C(C(C)C)=CCC2C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.442
CB1 binding score: -13.143
InChIKey:OKSXHUWOHUFHBL-UHFFFAOYSA-N
ID: 76721
SMILES:C1(O)=C(C(CC(=O)NCCO)c2ccc(O)c(OC)c2)C(=O)CC(C)C12Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 539.625
CB1 binding score: -15.616
InChIKey:RDBWXXBLYVMTKK-UHFFFAOYSA-N
ID: 76722
SMILES:C(CCC(=O)C(C)=CCCC1(C)Oc2c(c(C)cc(O)c2)C=C1)C(C)(C)OC
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 386.532
CB1 binding score: -11.971
InChIKey:JPTIUJZVEKJXSU-UHFFFAOYSA-N
ID: 76723
SMILES:C(CCCCCCC)CCc1cc2c(c(O)c1)C1C(C(C)(O)C)CCC(C)(O2)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.619
CB1 binding score: -14.347
InChIKey:QVPIUWBHEKRIKM-UHFFFAOYSA-N
ID: 76724
SMILES:C(C=C(C)C)CC(C)=CCCC(=CCc1c(O)cc(CCCCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 76725
SMILES:c1(CCCCC)cc2c(c(O)c1)C1C3(O)C(C(C)(C)OC3=O)CC3C(C)(C)OC(C)(CC1)C(Cl)CC32
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 519.122
CB1 binding score: -15.322
InChIKey:ZLOOPYMBSHWTJY-UHFFFAOYSA-N
ID: 76726
SMILES:C(C)(=C)C1CCC(C)=CC1c1c(O)cc(O)cc1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 258.361
CB1 binding score: -18.798
InChIKey:KDZOUSULXZNDJH-UHFFFAOYSA-N
ID: 76727
SMILES:C(C)(C)=CCCC(C1C2c3c(c(C(O)CCCCC)cc(O)c3)OC(C)(C)C2CC1OC(=O)C)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -11.975
InChIKey:BLAXHMVDZRWCFC-UHFFFAOYSA-N
ID: 76728
SMILES:C1(=O)CC(C(=C)C)C(c2c(O)cc(CCCC)cc2OC)C=C1C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.452
CB1 binding score: -16.182
InChIKey:KFVGUQQJMHCVGO-UHFFFAOYSA-N
ID: 76729
SMILES:C1C(O)CC(C)=CC12C(=O)c1c(OC)cc(CCCCC)cc1OC2(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.505
CB1 binding score: -14.479
InChIKey:APYCIXZAJWKXJE-UHFFFAOYSA-N
ID: 76730
SMILES:C(CC(=O)C(=C)C)C1(C)Oc2c(O)cc(CCC)cc2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 300.398
CB1 binding score: -14.488
InChIKey:YSZXPOVHICZGBM-UHFFFAOYSA-N
ID: 76731
SMILES:O(C(=O)C)Cc1cc2c(cc1CCCCC)OC1(C)CC2C(C(C)C)CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 372.549
CB1 binding score: -14.418
InChIKey:VDIZYTTTXWASJF-UHFFFAOYSA-N
ID: 76732
SMILES:C1=C(C)CCC2C(C)(C)Oc3cc(O)c(C(OC)=O)cc3C12
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -17.334
InChIKey:ATQYDNYKKOURKB-UHFFFAOYSA-N
ID: 76733
SMILES:C1C2(C)CCC3C(C)(C)Oc4c(c(O)c(CCCCC)cc4O)C13O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.467
CB1 binding score: -17.251
InChIKey:GSBOOIKXHJKSSK-UHFFFAOYSA-N
ID: 76734
SMILES:c1cc(COC2C=C(C)CCC3C(C)(C)Oc4c(C(C)C(OC(=O)C)C(CC)C)c(O)cc(O)c4C(OC)C3O2)ccc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 596.761
CB1 binding score: -14.426
InChIKey:RYFWTQGVFIRBFJ-UHFFFAOYSA-N