ID: 48763
SMILES:CC1=CC(c2ccc(CCCCC)cc2)C(C(C)C)CC1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 284.487
CB1 binding score: -19.108
InChIKey:KCGRQTUOQYSEJY-UHFFFAOYSA-N
ID: 48764
SMILES:O1c2cc(CCCCC)cc(O)c2C2OC(C)(C)C1C2
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 276.376
CB1 binding score: -17.339
InChIKey:BCWNXAPKXKMJHK-UHFFFAOYSA-N
ID: 48765
SMILES:C(C)CCCCCCCc1cc2c(c(O)c1)C1CC(C)(O2)CCC1C(=C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 370.577
CB1 binding score: -16.216
InChIKey:JNZGRTIYMBJPMS-UHFFFAOYSA-N
ID: 48766
SMILES:CC(C1=CCC2(C)C1CC(=O)C(C)=CC2Oc1cc(CCCCC)cc(OC)c1)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 410.598
CB1 binding score: -15.929
InChIKey:UGXCFBDOWPMMAH-UHFFFAOYSA-N
ID: 48767
SMILES:O1c2c(c(O)cc(CCCCC#CCCN)c2)C2(C)C(C)C(C)=CCC12C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 367.533
CB1 binding score: -14.639
InChIKey:DKRUNYKGJZGGRP-UHFFFAOYSA-N
ID: 48768
SMILES:C1C(C(=O)OC)(CC=C(C)C)c2cc(C3C(C(C)C)CCC(C)=C3)c(O)cc2o1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.543
CB1 binding score: -13.823
InChIKey:GLTCWWQTCXFPPN-UHFFFAOYSA-N
ID: 48769
SMILES:C1C2C(C(=C)C)CCC2(C)CC2=C(C)c3c(O)c(O)c(CCCCC)cc3OC2(C)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 424.625
CB1 binding score: -12.805
InChIKey:XREHLXJESRANDD-UHFFFAOYSA-N
ID: 48770
SMILES:C(C)(C1CCC(C)(C=O)C1c1c(O)cc(CCCCC)cc1O)=C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 330.468
CB1 binding score: -16.341
InChIKey:XBQZQPFPDZKUSE-UHFFFAOYSA-N
ID: 48771
SMILES:c1(CCN)cc(O)c(C2C(C(=C)C)CCC(C)=C2)c(O)c1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 287.403
CB1 binding score: -16.723
InChIKey:PEKACFVXZMHTHG-UHFFFAOYSA-N
ID: 48772
SMILES:C1C2C(O)(Cc3c(O)cc(CCCCC)c(O)c31)C(C)CC1C2C1(C)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.425
InChIKey:RJOYQODCHXOPLM-UHFFFAOYSA-N
ID: 48773
SMILES:c1c(C2(C)CC(C)CC(C)(CCCC(C)C(=O)O)O2)c(O)ccc1
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 334.456
CB1 binding score: -11.814
InChIKey:LKWSZOAUBLUTNA-UHFFFAOYSA-N
ID: 48774
SMILES:C=C(C1CCC2(C)C(C1(C)O)Oc1c(c(O)cc(CCCCC)c1)C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 358.522
CB1 binding score: -15.353
InChIKey:VBBONFRJPLWJSC-UHFFFAOYSA-N
ID: 48775
SMILES:C(Cc1cc(O)c2c(c1)C1C(C(C)(C)O2)CC=C(C)C1)(O)=O
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.37
CB1 binding score: -13.138
InChIKey:LBVREYYOXCOYRW-UHFFFAOYSA-N
ID: 48776
SMILES:C1(C)(C)C(O)C2C13Oc1cc(CCCCC)cc(O)c1C31C(C)CCC2C(C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 398.587
CB1 binding score: -16.451
InChIKey:ACGZTWUGXMADOS-UHFFFAOYSA-N
ID: 48777
SMILES:O(C(=O)c1c(CCCCC)cc(O)c2c1OC1(C)CCC3C(CO)(C)C3C1C2)C
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 402.531
CB1 binding score: -16.347
InChIKey:ODCYBURQKBWYHX-UHFFFAOYSA-N
ID: 48778
SMILES:c1(O)cc(C)cc2c1C(C)(CCC1C(C)(C)CCCC1(C)O)O2
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids;Tetraketide meroterpenoids
MW: 318.457
CB1 binding score: -15.749
InChIKey:MNWJVPCWQOVMRJ-UHFFFAOYSA-N
ID: 48779
SMILES:c12cc(O)c(C)cc1OC(C)(C)CCCC2(C)C(CC(CCC)C)C
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 346.555
CB1 binding score: -15.826
InChIKey:QYHKHFOTEYMEQI-UHFFFAOYSA-N
ID: 48780
SMILES:C1c2ccccc2C(c2c(O)c(OC)cc(CCCCCC)c2)C(C(C)=C)C1
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 378.556
CB1 binding score: -17.085
InChIKey:SIQODYSZMWIARL-UHFFFAOYSA-N
ID: 48781
SMILES:COc1c(C(C(OC(=O)C)C(CC2(C)OC(C)(C)C(OC(=O)C)C2)=O)CC)c(OCCCC)c(C)cc1OC
Pathway: Polyketides
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 550.689
CB1 binding score: -15.371
InChIKey:AZTPYUYZUWGMKH-UHFFFAOYSA-N
ID: 48782
SMILES:C1(C)=CC(c2c(CCCC)cc(O)cc2)CC(C(C)(C)O)C1
Pathway: Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 302.458
CB1 binding score: -12.124
InChIKey:JEGBUQWMLGYDBT-UHFFFAOYSA-N
ID: 48783
SMILES:C(CCCc1cc(O)c(CC=C(C)CCC=C(C)CCC=C(C)C)c(O)c1)CCC
Pathway: Polyketides;Terpenoids
Superclass: Meroterpenoids
Class: Cannabinoids
MW: 412.658
CB1 binding score: -16.036
InChIKey:YPAUMXQFHYZVDJ-UHFFFAOYSA-N