ID: 57562
SMILES:c1(O)c2c(cc(C(C(=O)O)C(CC)O)c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 360.45
CB1 binding score: -16.015
InChIKey:JTZARXMPOLRNND-UHFFFAOYSA-N
ID: 57563
SMILES:O1c2cc(CCCCC)cc(O)c2C2CC(C)CCC2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 316.485
CB1 binding score: -20.541
InChIKey:XKRHRBJLCLXSGE-UHFFFAOYSA-N
ID: 57564
SMILES:c1(O)c2c(cc(O)c1)OC1(CC=C(CCC=C(C)C)C)C(=O)C3=C(OC(C)(C)C4CC(=O)OC(C34)O1)C2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 510.583
CB1 binding score: -14.916
InChIKey:NYSIEFYFNBWBJO-UHFFFAOYSA-N
ID: 57565
SMILES:CC(=CCCC(C)=CCc1cc(OC)c(CCC)cc1O)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -16.335
InChIKey:GDSUMLRWLRBNDA-UHFFFAOYSA-N
ID: 57566
SMILES:CC1(C)Oc2cc(CCCCC)cc(O)c2C2CC(C)C(O)CC12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 332.484
CB1 binding score: -19.143
InChIKey:CIVSDEYXXUHBPV-UHFFFAOYSA-N
ID: 57567
SMILES:c1c(C=O)c2c(c(O)c1)C1C(C(C)(C)O2)CCC(C)(OOC)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 320.385
CB1 binding score: -13.311
InChIKey:HXTKMSKHLZBGBR-UHFFFAOYSA-N
ID: 57568
SMILES:C12C(Cl)C(Cl)(C(=CC=CC(C)(C)O)C)CCC1(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 467.477
CB1 binding score: -16.64
InChIKey:NBTLXKXFFGHAIV-UHFFFAOYSA-N
ID: 57569
SMILES:C(c1cc(O)c2c(c1)OC(C)(CCC=C(C)CCC=C(C)C)C=C2)(O)Cc1cc(O)ccc1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 448.603
CB1 binding score: -16.527
InChIKey:PYESXSVLVFNILA-UHFFFAOYSA-N
ID: 57570
SMILES:C(C)(C)=CC(CC(CO)=CCC(O)C1(C)CC2c3c(O)cc(CCCCC)cc3OC(C)(C1)C2)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 484.677
CB1 binding score: -14.024
InChIKey:GADAPGQNJYIJBB-UHFFFAOYSA-N
ID: 57571
SMILES:CC(C)=CCCC1(C)Oc2c(c(O)cc(CCCCCC)c2)C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -19.458
InChIKey:LZFSGTNLAZDDKK-UHFFFAOYSA-N
ID: 57572
SMILES:c1ccc2c(c1)C(CCC=C(C)C)(C)Oc1cc(CCCCC)cc(O)c12
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 364.529
CB1 binding score: -14.77
InChIKey:RSMARIWDZIZDEO-UHFFFAOYSA-N
ID: 57573
SMILES:c1(C)cc(O)c2c(c1)OC1(CC2(C)C)C(C)(O)CCCC1(CCCCCCCC)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 416.646
CB1 binding score: -16.259
InChIKey:HCFOYTHXKCVZGC-UHFFFAOYSA-N
ID: 57574
SMILES:C12=C(c3c(cc(CCCCC)c(C(=O)O)c3O)OC1(C)C)C(C)CCC2C(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 400.559
CB1 binding score: -16.327
InChIKey:WVRYLEQPZOWTCC-UHFFFAOYSA-N
ID: 57575
SMILES:C1(CCC=C(C)C)(C)Oc2cc(CCCCC)cc(O)c2C=C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 314.469
CB1 binding score: -20.933
InChIKey:UVOLYTDXHDXWJU-UHFFFAOYSA-N
ID: 57576
SMILES:CCCCCc1cc(O)c(CC=C(C)CCC=C(CCC=C(C)C)C)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 384.604
CB1 binding score: -20.123
InChIKey:WYEFRBILENQYOH-UHFFFAOYSA-N
ID: 57577
SMILES:c12c(c(O)cc(CCCCC)c1)C1C(C(C)(C)O2)CCC(C)(O)C1O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 348.483
CB1 binding score: -19.298
InChIKey:TZGCTXUTNDNTTE-UHFFFAOYSA-N
ID: 57578
SMILES:C12(c3c(O)cc(CCC)cc3OC1(C)C)CC(C)CC2
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 274.404
CB1 binding score: -16.709
InChIKey:STAVVZDVVXLOSM-UHFFFAOYSA-N
ID: 57579
SMILES:c12cc(C)ccc1C(C)(C)Oc1c-2c(O)cc(CCCCC)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 310.437
CB1 binding score: -19.554
InChIKey:VBGLYOIFKLUMQG-UHFFFAOYSA-N
ID: 57580
SMILES:CCCCCCc1cc(O)c2c(c1)OC(C)(C)C1C2CC(C)=CC1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 328.496
CB1 binding score: -20.649
InChIKey:ZHYPKENABBMAAN-UHFFFAOYSA-N
ID: 57581
SMILES:C1(=O)C2(C(C)C)Oc3c(ccc(CCCCC)c3)C2C=C(C)C1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 312.453
CB1 binding score: -13.737
InChIKey:HDHHQHMXVOJMDW-UHFFFAOYSA-N
ID: 57582
SMILES:O(CC)c1c(C2C(C(C)=C)C(c3c(OC)ccc(CC[N+](O)(C)C)c3)C2)cc(CCCCC)cc1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 480.713
CB1 binding score: -15.587
InChIKey:QDVVUYRIYASJQC-UHFFFAOYSA-N